U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H14O2S
Molecular Weight 162.25
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 4-(METHYLTHIO)BUTYRATE

SMILES

CCOC(=O)CCCSC

InChI

InChIKey=QNLREUZIHJHXRK-UHFFFAOYSA-N
InChI=1S/C7H14O2S/c1-3-9-7(8)5-4-6-10-2/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H14O2S
Molecular Weight 162.25
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:59:44 GMT 2025
Edited
by admin
on Mon Mar 31 19:59:44 GMT 2025
Record UNII
W0F51T4V09
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 3681
Preferred Name English
ETHYL 4-(METHYLTHIO)BUTYRATE
FHFI  
Systematic Name English
ETHYL 4-(METHYLTHIO)BUTYRATE [FHFI]
Common Name English
BUTANOIC ACID, 4-(METHYLTHIO)-, ETHYL ESTER
Common Name English
BUTYRIC ACID, 4-(METHYLTHIO)-, ETHYL ESTER
Common Name English
ETHYL 4-(METHYLTHIO)BUTANOATE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION ETHYL 4-(METHYLTHIO)BUTYRATE
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
Code System Code Type Description
ECHA (EC/EINECS)
244-720-5
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY
PUBCHEM
5463935
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY
CAS
22014-48-8
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY
JECFA MONOGRAPH
520
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY
FDA UNII
W0F51T4V09
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY
EPA CompTox
DTXSID70176463
Created by admin on Mon Mar 31 19:59:44 GMT 2025 , Edited by admin on Mon Mar 31 19:59:44 GMT 2025
PRIMARY